1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholinoethyl)thiourea CAS Name: 1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[2-(4-morpholinyl)ethyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 3-benzyl-1-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]-1-(2-morpholinoethyl)thiourea Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCN3CCOCC3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCN3CCOCC3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2S/c1-19-7-8-21-16-22(24(30)27-23(21)15-19)18-29(10-9-28-11-13-31-14-12-28)25(32)26-17-20-5-3-2-4-6-20/h2-8,15-16H,9-14,17-18H2,1H3,(H,26,32)(H,27,30)