[1-(1H-imidazol-5-ylmethyl)-7-piperidin-1-ylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-yl-methanone hydrochloride

Systemtic Name: [1-(1H-imidazol-5-ylmethyl)-7-piperidin-1-ylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-yl-methanone hydrochloride Openeye Name: [1-(1H-imidazol-5-ylmethyl)-7-(1-piperidylsulfonyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthyl)methanone hydrochloride CAS Name: [1-(1H-imidazol-5-ylmethyl)-7-(1-piperidinylsulfonyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthalenyl)methanone hydrochloride IUPAC Name: [1-(1H-imidazol-5-ylmethyl)-7-piperidin-1-ylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-naphthalen-1-ylmethanone hydrochloride Traditional Name: [1-(1H-imidazol-5-ylmethyl)-7-piperidinosulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]-(1-naphthyl)methanone hydrochloride Formula: C29H32ClN5O3S MolecularWeight: 566.11408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CCN(C3)C(=O)C4=CC=CC5=CC=CC=C54)CC6=CN=CN6.Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(CCN(C3)C(=O)C4=CC=CC5=CC=CC=C54)CC6=CN=CN6.Cl

InChI

InChI=1S/C29H31N5O3S.ClH/c35-29(27-10-6-8-22-7-2-3-9-26(22)27)33-16-15-32(20-24-18-30-21-31-24)28-12-11-25(17-23(28)19-33)38(36,37)34-13-4-1-5-14-34;/h2-3,6-12,17-18,21H,1,4-5,13-16,19-20H2,(H,30,31);1H