4-(azepan-1-ylsulfonyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)benzamide Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H24N4O3S2/c1-13(2)17-20-21-18(26-17)19-16(23)14-7-9-15(10-8-14)27(24,25)22-11-5-3-4-6-12-22/h7-10,13H,3-6,11-12H2,1-2H3,(H,19,21,23)