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

Systemtic Name: 1-cyclopentyl-1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Openeye Name: 1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea CAS Name: 1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea IUPAC Name: 1-cyclopentyl-1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylthiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-3-phenyl-thiourea Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-28-20-11-12-21-16(14-20)13-17(22(27)25-21)15-26(19-9-5-6-10-19)23(29)24-18-7-3-2-4-8-18/h2-4,7-8,11-14,19H,5-6,9-10,15H2,1H3,(H,24,29)(H,25,27)