2-[(phenylmethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(phenylmethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-(benzylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(phenylmethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-(benzylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-(benzylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C16H16N2S MolecularWeight: 268.37664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NCC3=CC=CC=C3)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NCC3=CC=CC=C3)C#N

InChI

InChI=1S/C16H16N2S/c17-10-14-13-8-4-5-9-15(13)19-16(14)18-11-12-6-2-1-3-7-12/h1-3,6-7,18H,4-5,8-9,11H2