N-[(E)-N'-(1,3-benzothiazol-2-yl)carbamimidoyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[(E)-N'-(1,3-benzothiazol-2-yl)carbamimidoyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[(E)-N'-(1,3-benzothiazol-2-yl)carbamimidoyl]-2-chloro-5-nitro-benzamide CAS Name: N-[(E)-amino(1,3-benzothiazol-2-ylimino)methyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[(E)-N'-(1,3-benzothiazol-2-yl)carbamimidoyl]-2-chloro-5-nitrobenzamide Traditional Name: N-[(E)-N'-(1,3-benzothiazol-2-yl)amidino]-2-chloro-5-nitro-benzamide Formula: C15H10ClN5O3S MolecularWeight: 375.7896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)N=C(N)NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/N=C(\N)/NC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H10ClN5O3S/c16-10-6-5-8(21(23)24)7-9(10)13(22)19-14(17)20-15-18-11-3-1-2-4-12(11)25-15/h1-7H,(H3,17,18,19,20,22)