2-(4-chlorophenyl)-7-methyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-(4-chlorophenyl)-7-methyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-chlorophenyl)-7-methyl-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 2-(4-chlorophenyl)-7-methyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-chlorophenyl)-7-methyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-chlorophenyl)-7-methyl-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C19H14ClN3S MolecularWeight: 351.85256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

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