1-[2-[[6-azanyl-3,5-dicyano-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]ethyl]-3-methyl-urea

Systemtic Name: 1-[2-[[6-azanyl-3,5-dicyano-4-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]ethyl]-3-methyl-urea Openeye Name: 1-[2-[[6-amino-3,5-dicyano-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]ethyl]-3-methyl-urea CAS Name: 1-[2-[[6-amino-3,5-dicyano-4-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyridin-2-yl]thio]ethyl]-3-methylurea IUPAC Name: 1-[2-[[6-amino-3,5-dicyano-4-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]sulfanyl]ethyl]-3-methylurea Traditional Name: 1-[2-[[6-amino-3,5-dicyano-4-(4-ketocyclohexa-2,5-dien-1-ylidene)-1H-pyridin-2-yl]thio]ethyl]-3-methyl-urea Formula: C17H16N6O2S MolecularWeight: 368.41294

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NCCSC1=C(C(=C2C=CC(=O)C=C2)C(=C(N1)N)C#N)C#N

Isomeric SMILES

CNC(=O)NCCSC1=C(C(=C2C=CC(=O)C=C2)C(=C(N1)N)C#N)C#N

InChI

InChI=1S/C17H16N6O2S/c1-21-17(25)22-6-7-26-16-13(9-19)14(12(8-18)15(20)23-16)10-2-4-11(24)5-3-10/h2-5,23H,6-7,20H2,1H3,(H2,21,22,25)