4-azanylidene-6-(4-chlorophenyl)-2-pyridin-2-yl-7H-1,3-thiazepine-5-carbonitrile

Systemtic Name: 4-azanylidene-6-(4-chlorophenyl)-2-pyridin-2-yl-7H-1,3-thiazepine-5-carbonitrile Openeye Name: 6-(4-chlorophenyl)-4-imino-2-(2-pyridyl)-7H-1,3-thiazepine-5-carbonitrile CAS Name: 6-(4-chlorophenyl)-4-imino-2-(2-pyridinyl)-7H-1,3-thiazepine-5-carbonitrile IUPAC Name: 6-(4-chlorophenyl)-4-imino-2-pyridin-2-yl-7H-1,3-thiazepine-5-carbonitrile Traditional Name: 6-(4-chlorophenyl)-4-imino-2-(2-pyridyl)-7H-1,3-thiazepine-5-carbonitrile Formula: C17H11ClN4S MolecularWeight: 338.81404

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(=N)N=C(S1)C2=CC=CC=N2)C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(=C(C(=N)N=C(S1)C2=CC=CC=N2)C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H11ClN4S/c18-12-6-4-11(5-7-12)14-10-23-17(15-3-1-2-8-21-15)22-16(20)13(14)9-19/h1-8,20H,10H2