1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea

Systemtic Name: 1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea Openeye Name: 1,3-dibenzyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1,3-bis(phenylmethyl)thiourea IUPAC Name: 1,3-dibenzyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1,3-dibenzyl-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CC3=CC=CC=C3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C26H25N3OS/c1-19-9-8-14-22-15-23(25(30)28-24(19)22)18-29(17-21-12-6-3-7-13-21)26(31)27-16-20-10-4-2-5-11-20/h2-15H,16-18H2,1H3,(H,27,31)(H,28,30)