4-[3-[2-(hydroxymethyl)-1,3-thiazol-4-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one

Systemtic Name: 4-[3-[2-(hydroxymethyl)-1,3-thiazol-4-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-[2-(hydroxymethyl)thiazol-4-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-[2-(hydroxymethyl)-4-thiazolyl]phenyl]-8-(1-pyrrolyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-[2-(hydroxymethyl)-1,3-thiazol-4-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(2-methylolthiazol-4-yl)phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Formula: C23H18N4O2S MolecularWeight: 414.47962

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)N3C=CC=C3)NC1=O)C4=CC=CC(=C4)C5=CSC(=N5)CO

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)N3C=CC=C3)NC1=O)C4=CC=CC(=C4)C5=CSC(=N5)CO

InChI

InChI=1S/C23H18N4O2S/c28-13-23-26-21(14-30-23)16-5-3-4-15(10-16)19-12-22(29)25-20-11-17(6-7-18(20)24-19)27-8-1-2-9-27/h1-11,14,28H,12-13H2,(H,25,29)