1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(4-methylphenyl)urea Openeye Name: 1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-(p-tolyl)urea CAS Name: 1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(4-methylphenyl)urea IUPAC Name: 1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-(4-methylphenyl)urea Traditional Name: 1-[(6R)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3-(p-tolyl)urea Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C#N)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H23N3OS/c1-3-4-14-7-10-16-17(12-21)19(25-18(16)11-14)23-20(24)22-15-8-5-13(2)6-9-15/h5-6,8-9,14H,3-4,7,10-11H2,1-2H3,(H2,22,23,24)/t14-/m1/s1