4-(azepan-1-yl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 4-(azepan-1-yl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 4-(azepan-1-yl)-3-nitro-N-thiazol-2-yl-benzamide CAS Name: 4-(1-azepanyl)-3-nitro-N-(2-thiazolyl)benzamide IUPAC Name: 4-(azepan-1-yl)-3-nitro-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 4-(azepan-1-yl)-3-nitro-N-thiazol-2-yl-benzamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=NC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O3S/c21-15(18-16-17-7-10-24-16)12-5-6-13(14(11-12)20(22)23)19-8-3-1-2-4-9-19/h5-7,10-11H,1-4,8-9H2,(H,17,18,21)