7-chloranyl-5-(4-methylphenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-chloranyl-5-(4-methylphenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-chloro-5-(p-tolyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-chloro-5-(4-methylphenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-chloro-5-(4-methylphenyl)-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-chloro-5-(p-tolyl)-2-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C19H14ClN3S MolecularWeight: 351.85256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CS4)Cl

InChI

InChI=1S/C19H14ClN3S/c1-12-4-6-13(7-5-12)18-15-11-14(20)8-9-16(15)21-19(23-22-18)17-3-2-10-24-17/h2-11,22H,1H3