1-[4-(3-nitrothiophen-2-yl)-1,4-thiazinan-1-ylidene]-3-(5-pyridin-2-ylthiophen-2-yl)urea

Systemtic Name: 1-[4-(3-nitrothiophen-2-yl)-1,4-thiazinan-1-ylidene]-3-(5-pyridin-2-ylthiophen-2-yl)urea Openeye Name: 1-[4-(3-nitro-2-thienyl)-1,4-thiazinan-1-ylidene]-3-[5-(2-pyridyl)-2-thienyl]urea CAS Name: 1-[4-(3-nitro-2-thiophenyl)-1,4-thiazinan-1-ylidene]-3-[5-(2-pyridinyl)-2-thiophenyl]urea IUPAC Name: 1-[4-(3-nitrothiophen-2-yl)-1,4-thiazinan-1-ylidene]-3-(5-pyridin-2-ylthiophen-2-yl)urea Traditional Name: 1-[4-(3-nitro-2-thienyl)-1,4-thiazinan-1-ylidene]-3-[5-(2-pyridyl)-2-thienyl]urea Formula: C18H17N5O3S3 MolecularWeight: 447.55428

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=NC(=O)NC2=CC=C(S2)C3=CC=CC=N3)CCN1C4=C(C=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CS(=NC(=O)NC2=CC=C(S2)C3=CC=CC=N3)CCN1C4=C(C=CS4)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O3S3/c24-18(20-16-5-4-15(28-16)13-3-1-2-7-19-13)21-29-11-8-22(9-12-29)17-14(23(25)26)6-10-27-17/h1-7,10H,8-9,11-12H2,(H,20,24)