N-[5-chloranyl-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide

Systemtic Name: N-[5-chloranyl-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide Openeye Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide CAS Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide IUPAC Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitrobenzamide Traditional Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-3-nitro-benzamide Formula: C18H16ClN3O4S MolecularWeight: 405.85534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])S2)CCOC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])S2)CCOC)Cl

InChI

InChI=1S/C18H16ClN3O4S/c1-11-14(19)6-7-15-16(11)21(8-9-26-2)18(27-15)20-17(23)12-4-3-5-13(10-12)22(24)25/h3-7,10H,8-9H2,1-2H3