4-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2-dimethylaminoethyl)-N-(6-ethyl-1,3-benzothiazol-2-yl)benzamide Formula: C26H34N4O3S2 MolecularWeight: 514.70316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCN(C)C)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H34N4O3S2/c1-4-20-9-14-23-24(19-20)34-26(27-23)30(18-17-28(2)3)25(31)21-10-12-22(13-11-21)35(32,33)29-15-7-5-6-8-16-29/h9-14,19H,4-8,15-18H2,1-3H3