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

Systemtic Name: 4-[3-[4-(hydroxymethyl)-1,3-thiazol-2-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Openeye Name: 4-[3-[4-(hydroxymethyl)thiazol-2-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one CAS Name: 4-[3-[4-(hydroxymethyl)-2-thiazolyl]phenyl]-8-(1-pyrrolyl)-1,3-dihydro-1,5-benzodiazepin-2-one IUPAC Name: 4-[3-[4-(hydroxymethyl)-1,3-thiazol-2-yl]phenyl]-8-pyrrol-1-yl-1,3-dihydro-1,5-benzodiazepin-2-one Traditional Name: 4-[3-(4-methylolthiazol-2-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=NC(=CS5)CO

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)N3C=CC=C3)NC1=O)C4=CC=CC(=C4)C5=NC(=CS5)CO

InChI

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