[4-[(3-bromanyl-4-methoxy-phenyl)carbamoyl]-2-(4-methoxyphenyl)-1,2,3-thiadiazol-5-ylidene]azanium

Systemtic Name: [4-[(3-bromanyl-4-methoxy-phenyl)carbamoyl]-2-(4-methoxyphenyl)-1,2,3-thiadiazol-5-ylidene]azanium Openeye Name: [4-[(3-bromo-4-methoxy-phenyl)carbamoyl]-2-(4-methoxyphenyl)thiadiazol-5-ylidene]ammonium CAS Name: [4-[(3-bromo-4-methoxyanilino)-oxomethyl]-2-(4-methoxyphenyl)-5-thiadiazolylidene]ammonium IUPAC Name: [4-[(3-bromo-4-methoxyphenyl)carbamoyl]-2-(4-methoxyphenyl)thiadiazol-5-ylidene]azanium Traditional Name: [4-[(3-bromo-4-methoxy-phenyl)carbamoyl]-2-(4-methoxyphenyl)thiadiazol-5-ylidene]ammonium Formula: C17H16BrN4O3S+ MolecularWeight: 436.30294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2N=C(C(=[NH2+])S2)C(=O)NC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2N=C(C(=[NH2+])S2)C(=O)NC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C17H15BrN4O3S/c1-24-12-6-4-11(5-7-12)22-21-15(16(19)26-22)17(23)20-10-3-8-14(25-2)13(18)9-10/h3-9,19H,1-2H3,(H,20,23)/p+1