11-(4-azanyl-2,2,6,6-tetramethyl-piperidin-1-yl)-2-(cyclopropylamino)-7-(2-methylsulfanylethyl)-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one

Systemtic Name: 11-(4-azanyl-2,2,6,6-tetramethyl-piperidin-1-yl)-2-(cyclopropylamino)-7-(2-methylsulfanylethyl)-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Openeye Name: 11-(4-amino-2,2,6,6-tetramethyl-1-piperidyl)-2-(cyclopropylamino)-7-(2-methylsulfanylethyl)-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one CAS Name: 11-(4-amino-2,2,6,6-tetramethyl-1-piperidinyl)-2-(cyclopropylamino)-7-[2-(methylthio)ethyl]-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one IUPAC Name: 11-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-2-(cyclopropylamino)-7-(2-methylsulfanylethyl)-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Traditional Name: 11-(4-amino-2,2,6,6-tetramethyl-piperidino)-2-(cyclopropylamino)-7-[2-(methylthio)ethyl]-7,13-dihydrobenzimidazolo[1,2-d][1,4]benzodiazepin-6-one Formula: C30H40N6OS MolecularWeight: 532.7432

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1C2=CC3=C(C=C2)N4C(C(=O)N=C5C=CC(=CC5=C4N3)NC6CC6)CCSC)(C)C)N)C

Isomeric SMILES

CC1(CC(CC(N1C2=CC3=C(C=C2)N4C(C(=O)N=C5C=CC(=CC5=C4N3)NC6CC6)CCSC)(C)C)N)C

InChI

InChI=1S/C30H40N6OS/c1-29(2)16-18(31)17-30(3,4)36(29)21-9-11-25-24(15-21)33-27-22-14-20(32-19-6-7-19)8-10-23(22)34-28(37)26(35(25)27)12-13-38-5/h8-11,14-15,18-19,26,32-33H,6-7,12-13,16-17,31H2,1-5H3