N,N-diethyl-3,5-dimethyl-1-[2-[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]pyrazole-4-sulfonamide

Systemtic Name: N,N-diethyl-3,5-dimethyl-1-[2-[(4R)-4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxidanylidene-ethyl]pyrazole-4-sulfonamide Openeye Name: N,N-diethyl-3,5-dimethyl-1-[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxo-ethyl]pyrazole-4-sulfonamide CAS Name: N,N-diethyl-3,5-dimethyl-1-[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]-4-pyrazolesulfonamide IUPAC Name: N,N-diethyl-3,5-dimethyl-1-[2-[(4R)-4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]-2-oxoethyl]pyrazole-4-sulfonamide Traditional Name: N,N-diethyl-1-[2-keto-2-[(4R)-2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethyl]-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)CC(=O)N2C(CC(=O)NC3=CC=CC=C32)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)CC(=O)N2[C@@H](CC(=O)NC3=CC=CC=C32)C)C

InChI

InChI=1S/C21H29N5O4S/c1-6-24(7-2)31(29,30)21-15(4)23-25(16(21)5)13-20(28)26-14(3)12-19(27)22-17-10-8-9-11-18(17)26/h8-11,14H,6-7,12-13H2,1-5H3,(H,22,27)/t14-/m1/s1