1-[2-(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(4-iodophenyl)thiourea

Systemtic Name: 1-[2-(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(4-iodophenyl)thiourea Openeye Name: 1-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-iodophenyl)thiourea CAS Name: 1-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-iodophenyl)thiourea IUPAC Name: 1-[2-(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-iodophenyl)thiourea Traditional Name: 1-(4-iodophenyl)-3-[2-(2-keto-7,8-dimethyl-1H-quinolin-3-yl)ethyl]thiourea Formula: C20H20IN3OS MolecularWeight: 477.36177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)I)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)I)C

InChI

InChI=1S/C20H20IN3OS/c1-12-3-4-14-11-15(19(25)24-18(14)13(12)2)9-10-22-20(26)23-17-7-5-16(21)6-8-17/h3-8,11H,9-10H2,1-2H3,(H,24,25)(H2,22,23,26)