1-cyclopentyl-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-cyclopentyl-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-benzyl-1-cyclopentyl-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-29-21-11-12-22-18(14-21)13-19(23(28)26-22)16-27(20-9-5-6-10-20)24(30)25-15-17-7-3-2-4-8-17/h2-4,7-8,11-14,20H,5-6,9-10,15-16H2,1H3,(H,25,30)(H,26,28)