1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]urea Openeye Name: 1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]urea CAS Name: 1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]urea Traditional Name: 1-(3-chlorophenyl)-3-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]urea Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3OS/c1-10-5-6-13-14(9-19)16(23-15(13)7-10)21-17(22)20-12-4-2-3-11(18)8-12/h2-4,8,10H,5-7H2,1H3,(H2,20,21,22)/t10-/m0/s1