[4-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [4-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [4-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-(1-naphthyl)methanone CAS Name: [4-(1H-imidazol-5-ylmethyl)-3-[2-(methylthio)ethyl]-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-(1-naphthalenyl)methanone IUPAC Name: [4-(1H-imidazol-5-ylmethyl)-3-(2-methylsulfanylethyl)-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [4-(1H-imidazol-5-ylmethyl)-3-[2-(methylthio)ethyl]-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]-(1-naphthyl)methanone Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1CN(C2=CC=CC=C2CN1CC3=CN=CN3)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CSCCC1CN(C2=CC=CC=C2CN1CC3=CN=CN3)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H28N4OS/c1-33-14-13-23-18-31(27(32)25-11-6-9-20-7-2-4-10-24(20)25)26-12-5-3-8-21(26)16-30(23)17-22-15-28-19-29-22/h2-12,15,19,23H,13-14,16-18H2,1H3,(H,28,29)