1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholinopropyl)thiourea CAS Name: 1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[3-(4-morpholinyl)propyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-benzyl-1-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-3-(3-morpholinopropyl)thiourea Formula: C27H34N4O2S MolecularWeight: 478.64946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CC=C3)C(=S)NCCCN4CCOCC4)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=O)NC2=C1)CN(CC3=CC=CC=C3)C(=S)NCCCN4CCOCC4)C

InChI

InChI=1S/C27H34N4O2S/c1-20-15-21(2)24-17-23(26(32)29-25(24)16-20)19-31(18-22-7-4-3-5-8-22)27(34)28-9-6-10-30-11-13-33-14-12-30/h3-5,7-8,15-17H,6,9-14,18-19H2,1-2H3,(H,28,34)(H,29,32)