N-[(E)-3-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(E)-3-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-3-oxidanylidene-1-pyridin-3-yl-prop-1-en-2-yl]thiophene-2-carboxamide Openeye Name: N-[(E)-1-[(4-guanidinosulfonylphenyl)carbamoyl]-2-(3-pyridyl)vinyl]thiophene-2-carboxamide CAS Name: N-[(E)-3-[4-(diaminomethylideneamino)sulfonylanilino]-3-oxo-1-(3-pyridinyl)prop-1-en-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(E)-3-[4-(diaminomethylideneamino)sulfonylanilino]-3-oxo-1-pyridin-3-ylprop-1-en-2-yl]thiophene-2-carboxamide Traditional Name: N-[(E)-1-[(4-guanidinosulfonylphenyl)carbamoyl]-2-(3-pyridyl)vinyl]thiophene-2-carboxamide Formula: C20H18N6O4S2 MolecularWeight: 470.52472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C=C(C(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CN=C1)/C=C(\C(=O)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N)/NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H18N6O4S2/c21-20(22)26-32(29,30)15-7-5-14(6-8-15)24-18(27)16(11-13-3-1-9-23-12-13)25-19(28)17-4-2-10-31-17/h1-12H,(H,24,27)(H,25,28)(H4,21,22,26)/b16-11+