(Z)-3-[(6-chloranylpyridin-3-yl)methylamino]-3-(methylamino)-N-methylsulfonyl-2-nitro-prop-2-enethioamide

Systemtic Name: (Z)-3-[(6-chloranylpyridin-3-yl)methylamino]-3-(methylamino)-N-methylsulfonyl-2-nitro-prop-2-enethioamide Openeye Name: (Z)-3-[(6-chloro-3-pyridyl)methylamino]-3-(methylamino)-N-methylsulfonyl-2-nitro-prop-2-enethioamide CAS Name: (Z)-3-[(6-chloro-3-pyridinyl)methylamino]-3-(methylamino)-N-methylsulfonyl-2-nitro-2-propenethioamide IUPAC Name: (Z)-3-[(6-chloropyridin-3-yl)methylamino]-3-(methylamino)-N-methylsulfonyl-2-nitroprop-2-enethioamide Traditional Name: (Z)-3-[(6-chloro-3-pyridyl)methylamino]-N-mesyl-3-(methylamino)-2-nitro-thioacrylamide Formula: C11H14ClN5O4S2 MolecularWeight: 379.84296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=C(C(=S)NS(=O)(=O)C)[N+](=O)[O-])NCC1=CN=C(C=C1)Cl

Isomeric SMILES

CN/C(=C(\C(=S)NS(=O)(=O)C)/[N+](=O)[O-])/NCC1=CN=C(C=C1)Cl

InChI

InChI=1S/C11H14ClN5O4S2/c1-13-10(15-6-7-3-4-8(12)14-5-7)9(17(18)19)11(22)16-23(2,20)21/h3-5,13,15H,6H2,1-2H3,(H,16,22)/b10-9-