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

Systemtic Name: N-[5-chloranyl-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-4-nitro-benzamide Openeye Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-4-nitro-benzamide CAS Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-4-nitrobenzamide IUPAC Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-4-nitrobenzamide Traditional Name: N-[5-chloro-3-(2-methoxyethyl)-4-methyl-1,3-benzothiazol-2-ylidene]-4-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=C(C=C3)[N+](=O)[O-])S2)CCOC)Cl

Isomeric SMILES

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

InChI

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