(Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitrothiophen-2-yl)prop-2-enamide

Systemtic Name: (Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitrothiophen-2-yl)prop-2-enamide Openeye Name: (Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitro-2-thienyl)prop-2-enamide CAS Name: (Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitro-2-thiophenyl)-2-propenamide IUPAC Name: (Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitrothiophen-2-yl)prop-2-enamide Traditional Name: (Z)-N-[3-(2-methoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-3-(5-nitro-2-thienyl)acrylamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C=CC3=CC=C(S3)[N+](=O)[O-])S2)CCOC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)/C=C\C3=CC=C(S3)[N+](=O)[O-])S2)CCOC

InChI

InChI=1S/C18H17N3O4S2/c1-12-3-6-14-15(11-12)27-18(20(14)9-10-25-2)19-16(22)7-4-13-5-8-17(26-13)21(23)24/h3-8,11H,9-10H2,1-2H3/b7-4-,19-18?