7-ethyl-8-ethylsulfanyl-5-(4-methylphenyl)-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-ethyl-8-ethylsulfanyl-5-(4-methylphenyl)-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-ethyl-8-ethylsulfanyl-5-(p-tolyl)-3H-1,4-benzodiazepin-2-amine CAS Name: 7-ethyl-8-(ethylthio)-5-(4-methylphenyl)-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-ethyl-8-ethylsulfanyl-5-(4-methylphenyl)-3H-1,4-benzodiazepin-2-amine Traditional Name: [7-ethyl-8-(ethylthio)-5-(p-tolyl)-3H-1,4-benzodiazepin-2-yl]amine Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=NCC(=N2)N)C3=CC=C(C=C3)C)SCC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=NCC(=N2)N)C3=CC=C(C=C3)C)SCC

InChI

InChI=1S/C20H23N3S/c1-4-14-10-16-17(11-18(14)24-5-2)23-19(21)12-22-20(16)15-8-6-13(3)7-9-15/h6-11H,4-5,12H2,1-3H3,(H2,21,23)