1-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-phenethyl-thiourea

Systemtic Name: 1-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-phenethyl-thiourea Openeye Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-phenethyl-thiourea CAS Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-phenethylthiourea IUPAC Name: 1-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-phenethylthiourea Traditional Name: 1-[2-(2-keto-6,7-dimethyl-1H-quinolin-3-yl)ethyl]-3-phenethyl-thiourea Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNC(=S)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CCNC(=S)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3OS/c1-15-12-19-14-18(21(26)25-20(19)13-16(15)2)9-11-24-22(27)23-10-8-17-6-4-3-5-7-17/h3-7,12-14H,8-11H2,1-2H3,(H,25,26)(H2,23,24,27)