1-(3-methylphenyl)-3-(1-thiophen-2-ylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)urea

Systemtic Name: 1-(3-methylphenyl)-3-(1-thiophen-2-ylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)urea Openeye Name: 1-(m-tolyl)-3-[1-(thiophene-2-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]urea CAS Name: 1-(3-methylphenyl)-3-[1-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-2H-quinolin-6-yl]urea IUPAC Name: 1-(3-methylphenyl)-3-[1-(thiophene-2-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]urea Traditional Name: 1-(m-tolyl)-3-[1-(2-thenoyl)-3,4-dihydro-2H-quinolin-6-yl]urea Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S/c1-15-5-2-7-17(13-15)23-22(27)24-18-9-10-19-16(14-18)6-3-11-25(19)21(26)20-8-4-12-28-20/h2,4-5,7-10,12-14H,3,6,11H2,1H3,(H2,23,24,27)