1-pentan-3-yl-3-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-6-yl]urea

Systemtic Name: 1-pentan-3-yl-3-[1-(phenylsulfonyl)-3,4-dihydro-2H-quinolin-6-yl]urea Openeye Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]-3-(1-ethylpropyl)urea CAS Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]-3-pentan-3-ylurea IUPAC Name: 1-[1-(benzenesulfonyl)-3,4-dihydro-2H-quinolin-6-yl]-3-pentan-3-ylurea Traditional Name: 1-(1-besyl-3,4-dihydro-2H-quinolin-6-yl)-3-(1-ethylpropyl)urea Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)NC1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(CC)NC(=O)NC1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3S/c1-3-17(4-2)22-21(25)23-18-12-13-20-16(15-18)9-8-14-24(20)28(26,27)19-10-6-5-7-11-19/h5-7,10-13,15,17H,3-4,8-9,14H2,1-2H3,(H2,22,23,25)