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

Systemtic Name: 1-(phenylmethyl)-3-(1-thiophen-2-ylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)urea Openeye Name: 1-benzyl-3-[1-(thiophene-2-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]urea CAS Name: 1-[1-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-2H-quinolin-6-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[1-(thiophene-2-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]urea Traditional Name: 1-benzyl-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:

C1CC2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)N(C1)C(=O)C4=CC=CS4

Isomeric SMILES

C1CC2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)N(C1)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S/c26-21(20-9-5-13-28-20)25-12-4-8-17-14-18(10-11-19(17)25)24-22(27)23-15-16-6-2-1-3-7-16/h1-3,5-7,9-11,13-14H,4,8,12,15H2,(H2,23,24,27)