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

Systemtic Name: 1-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea CAS Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]thiourea Traditional Name: 1-benzyl-3-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]thiourea Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-25-17-8-7-15-11-16(19(24)23-18(15)12-17)9-10-21-20(26)22-13-14-5-3-2-4-6-14/h2-8,11-12H,9-10,13H2,1H3,(H,23,24)(H2,21,22,26)