(3-phenylcinnolin-4-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-phenylcinnolin-4-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (3-phenylcinnolin-4-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-phenyl-4-cinnolinyl)-[4-(2-thiazolylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (3-phenylcinnolin-4-yl)-[4-(1,3-thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (3-phenylcinnolin-4-yl)-[4-(thiazol-2-ylmethyl)-1,4-diazepan-1-yl]methanone Formula: C24H23N5OS MolecularWeight: 429.53732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=C(N=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=NC=CS5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=C(N=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=NC=CS5

InChI

InChI=1S/C24H23N5OS/c30-24(29-13-6-12-28(14-15-29)17-21-25-11-16-31-21)22-19-9-4-5-10-20(19)26-27-23(22)18-7-2-1-3-8-18/h1-5,7-11,16H,6,12-15,17H2