N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-prop-2-enyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloranyl-3-nitro-phenyl)sulfonyl-prop-2-enyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[allyl-(4-chloro-3-nitro-phenyl)sulfonyl-amino]-N-(1,3-benzodioxol-5-ylmethyl)-N-(2-thienylmethyl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-nitrophenyl)sulfonyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-chloro-3-nitrophenyl)sulfonyl-prop-2-enylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[allyl-(4-chloro-3-nitro-phenyl)sulfonyl-amino]-N-piperonyl-N-(2-thenyl)acetamide Formula: C24H22ClN3O7S2 MolecularWeight: 564.03038

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C=CCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CS3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H22ClN3O7S2/c1-2-9-27(37(32,33)19-6-7-20(25)21(12-19)28(30)31)15-24(29)26(14-18-4-3-10-36-18)13-17-5-8-22-23(11-17)35-16-34-22/h2-8,10-12H,1,9,13-16H2