3-chloranyl-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-(4-ethylpiperazino)sulfonylphenyl]benzothiophene-2-carboxamide Formula: C21H22ClN3O3S2 MolecularWeight: 464.00068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H22ClN3O3S2/c1-2-24-11-13-25(14-12-24)30(27,28)16-9-7-15(8-10-16)23-21(26)20-19(22)17-5-3-4-6-18(17)29-20/h3-10H,2,11-14H2,1H3,(H,23,26)