3-(6,7-dihydro-[1]benzothiepino[5,4-b]indol-12-yl)propanenitrile

Systemtic Name: 3-(6,7-dihydro-[1]benzothiepino[5,4-b]indol-12-yl)propanenitrile Openeye Name: 3-(6,7-dihydro-[1]benzothiepino[5,4-b]indol-12-yl)propanenitrile CAS Name: 3-(6,7-dihydro-[1]benzothiepino[5,4-b]indol-12-yl)propanenitrile IUPAC Name: 3-(6,7-dihydro-[1]benzothiepino[5,4-b]indol-12-yl)propanenitrile Traditional Name: 3-(6,7-dihydro-[1]benzothiepin[5,4-b]indol-12-yl)propionitrile Formula: C19H16N2S MolecularWeight: 304.40874

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C3=C1C4=CC=CC=C4N3CCC#N

Isomeric SMILES

C1CSC2=CC=CC=C2C3=C1C4=CC=CC=C4N3CCC#N

InChI

InChI=1S/C19H16N2S/c20-11-5-12-21-17-8-3-1-6-14(17)15-10-13-22-18-9-4-2-7-16(18)19(15)21/h1-4,6-9H,5,10,12-13H2