1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(2-thienylmethyl)thiourea CAS Name: 1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-benzyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-1-(2-thenyl)thiourea Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC=CS3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O2S2/c1-29-20-10-9-18-12-19(23(28)26-22(18)13-20)15-27(16-21-8-5-11-31-21)24(30)25-14-17-6-3-2-4-7-17/h2-13H,14-16H2,1H3,(H,25,30)(H,26,28)