(4S)-4-methyl-5-[2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-4-methyl-5-[2-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-5-[2-(1-isopropyltetrazol-5-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-4-methyl-5-[1-oxo-2-[(1-propan-2-yl-5-tetrazolyl)thio]ethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-4-methyl-5-[2-(1-propan-2-yltetrazol-5-yl)sulfanylacetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-5-[2-[(1-isopropyltetrazol-5-yl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C16H20N6O2S MolecularWeight: 360.434

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NN=NN3C(C)C

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NN=NN3C(C)C

InChI

InChI=1S/C16H20N6O2S/c1-10(2)22-16(18-19-20-22)25-9-15(24)21-11(3)8-14(23)17-12-6-4-5-7-13(12)21/h4-7,10-11H,8-9H2,1-3H3,(H,17,23)/t11-/m0/s1