5-(4-chlorophenyl)-N-methyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 5-(4-chlorophenyl)-N-methyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-amine Openeye Name: 5-(4-chlorophenyl)-N-methyl-3-(2-thienyl)-3H-1,4-benzodiazepin-2-amine CAS Name: 5-(4-chlorophenyl)-N-methyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 5-(4-chlorophenyl)-N-methyl-3-thiophen-2-yl-3H-1,4-benzodiazepin-2-amine Traditional Name: [5-(4-chlorophenyl)-3-(2-thienyl)-3H-1,4-benzodiazepin-2-yl]-methyl-amine Formula: C20H16ClN3S MolecularWeight: 365.87914

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC2=CC=CC=C2C(=NC1C3=CC=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CNC1=NC2=CC=CC=C2C(=NC1C3=CC=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN3S/c1-22-20-19(17-7-4-12-25-17)24-18(13-8-10-14(21)11-9-13)15-5-2-3-6-16(15)23-20/h2-12,19H,1H3,(H,22,23)