N-(ethylcarbamoyl)-2-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propanamide

Systemtic Name: N-(ethylcarbamoyl)-2-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propanamide Openeye Name: N-(ethylcarbamoyl)-2-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]propanamide CAS Name: N-(ethylcarbamoyl)-2-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]propanamide IUPAC Name: N-(ethylcarbamoyl)-2-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]propanamide Traditional Name: N-(ethylcarbamoyl)-2-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazino]propionamide Formula: C20H30N6O7S MolecularWeight: 498.5532

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)C(C)N1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H30N6O7S/c1-3-21-20(28)22-19(27)15(2)23-6-8-24(9-7-23)17-5-4-16(14-18(17)26(29)30)34(31,32)25-10-12-33-13-11-25/h4-5,14-15H,3,6-13H2,1-2H3,(H2,21,22,27,28)