1-[3-(dimethylamino)propyl]-1-[3-[5-[3-[3-(dimethylamino)propyl-[(phenylmethyl)carbamoyl]amino]propyl]-9,9-dimethyl-xanthen-4-yl]propyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[3-(dimethylamino)propyl]-1-[3-[5-[3-[3-(dimethylamino)propyl-[(phenylmethyl)carbamoyl]amino]propyl]-9,9-dimethyl-xanthen-4-yl]propyl]-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[3-[5-[3-[benzylcarbamoyl-[3-(dimethylamino)propyl]amino]propyl]-9,9-dimethyl-xanthen-4-yl]propyl]-1-[3-(dimethylamino)propyl]urea CAS Name: 1-[3-(dimethylamino)propyl]-1-[3-[5-[3-[3-(dimethylamino)propyl-[oxo-[(phenylmethyl)amino]methyl]amino]propyl]-9,9-dimethyl-4-xanthenyl]propyl]-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[3-[5-[3-[benzylcarbamoyl-[3-(dimethylamino)propyl]amino]propyl]-9,9-dimethylxanthen-4-yl]propyl]-1-[3-(dimethylamino)propyl]urea Traditional Name: 3-benzyl-1-[3-[5-[3-[benzylcarbamoyl-[3-(dimethylamino)propyl]amino]propyl]-9,9-dimethyl-xanthen-4-yl]propyl]-1-[3-(dimethylamino)propyl]urea Formula: C47H64N6O3 MolecularWeight: 761.04946

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=CC=C2)CCCN(CCCN(C)C)C(=O)NCC3=CC=CC=C3)OC4=C1C=CC=C4CCCN(CCCN(C)C)C(=O)NCC5=CC=CC=C5)C

Isomeric SMILES

CC1(C2=C(C(=CC=C2)CCCN(CCCN(C)C)C(=O)NCC3=CC=CC=C3)OC4=C1C=CC=C4CCCN(CCCN(C)C)C(=O)NCC5=CC=CC=C5)C

InChI

InChI=1S/C47H64N6O3/c1-47(2)41-27-13-23-39(25-15-31-52(33-17-29-50(3)4)45(54)48-35-37-19-9-7-10-20-37)43(41)56-44-40(24-14-28-42(44)47)26-16-32-53(34-18-30-51(5)6)46(55)49-36-38-21-11-8-12-22-38/h7-14,19-24,27-28H,15-18,25-26,29-36H2,1-6H3,(H,48,54)(H,49,55)