1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea

Systemtic Name: 1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Openeye Name: 1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea CAS Name: 1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea IUPAC Name: 1-[3-(dimethylamino)propyl]-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenethylthiourea Traditional Name: 1-[3-(dimethylamino)propyl]-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-phenethyl-thiourea Formula: C26H34N4OS MolecularWeight: 450.63936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCCN(C)C)C(=S)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CCCN(C)C)C(=S)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C26H34N4OS/c1-19-15-20(2)23-17-22(25(31)28-24(23)16-19)18-30(14-8-13-29(3)4)26(32)27-12-11-21-9-6-5-7-10-21/h5-7,9-10,15-17H,8,11-14,18H2,1-4H3,(H,27,32)(H,28,31)