(3S)-3-(hydroxymethyl)-5-phenyl-8-piperazin-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: (3S)-3-(hydroxymethyl)-5-phenyl-8-piperazin-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: (3S)-3-(hydroxymethyl)-5-phenyl-8-piperazin-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: (3S)-3-(hydroxymethyl)-5-phenyl-8-(1-piperazinyl)-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: (3S)-3-(hydroxymethyl)-5-phenyl-8-piperazin-1-yl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: (3S)-3-methylol-5-phenyl-8-piperazino-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC3=C(C=C2)C(=NC(C(=O)N3)CO)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)C2=CC3=C(C=C2)C(=N[C@H](C(=O)N3)CO)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4O2/c25-13-18-20(26)23-17-12-15(24-10-8-21-9-11-24)6-7-16(17)19(22-18)14-4-2-1-3-5-14/h1-7,12,18,21,25H,8-11,13H2,(H,23,26)/t18-/m0/s1