(5Z)-1-butyl-5-[5-(4-nitrophenyl)pyrazolidin-3-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-1-butyl-5-[5-(4-nitrophenyl)pyrazolidin-3-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-1-butyl-5-[5-(4-nitrophenyl)pyrazolidin-3-ylidene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-1-butyl-5-[5-(4-nitrophenyl)-3-pyrazolidinylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-1-butyl-5-[5-(4-nitrophenyl)pyrazolidin-3-ylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-1-butyl-5-[5-(4-nitrophenyl)pyrazolidin-3-ylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H19N5O4S MolecularWeight: 389.42886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C2CC(NN2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C\2/CC(NN2)C3=CC=C(C=C3)[N+](=O)[O-])/C(=O)NC1=S

InChI

InChI=1S/C17H19N5O4S/c1-2-3-8-21-16(24)14(15(23)18-17(21)27)13-9-12(19-20-13)10-4-6-11(7-5-10)22(25)26/h4-7,12,19-20H,2-3,8-9H2,1H3,(H,18,23,27)/b14-13-