7-methylsulfanyl-5-phenyl-N-prop-2-ynyl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-methylsulfanyl-5-phenyl-N-prop-2-ynyl-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-methylsulfanyl-5-phenyl-N-prop-2-ynyl-3H-1,4-benzodiazepin-2-amine CAS Name: 7-(methylthio)-5-phenyl-N-prop-2-ynyl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-methylsulfanyl-5-phenyl-N-prop-2-ynyl-3H-1,4-benzodiazepin-2-amine Traditional Name: [7-(methylthio)-5-phenyl-3H-1,4-benzodiazepin-2-yl]-propargyl-amine Formula: C19H17N3S MolecularWeight: 319.42338

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(CN=C2C3=CC=CC=C3)NCC#C

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(CN=C2C3=CC=CC=C3)NCC#C

InChI

InChI=1S/C19H17N3S/c1-3-11-20-18-13-21-19(14-7-5-4-6-8-14)16-12-15(23-2)9-10-17(16)22-18/h1,4-10,12H,11,13H2,2H3,(H,20,22)