6-chloranyl-2-[[4-methyl-5-(thiophen-3-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole

Systemtic Name: 6-chloranyl-2-[[4-methyl-5-(thiophen-3-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole Openeye Name: 6-chloro-2-[[4-methyl-5-(3-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole CAS Name: 6-chloro-2-[[4-methyl-5-(3-thiophenylmethyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole IUPAC Name: 6-chloro-2-[[4-methyl-5-(thiophen-3-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-1,3-benzothiazole Traditional Name: 6-chloro-2-[[4-methyl-5-(3-thenyl)-1,2,4-triazol-3-yl]thio]-1,3-benzothiazole Formula: C15H11ClN4S3 MolecularWeight: 378.92264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=NC3=C(S2)C=C(C=C3)Cl)CC4=CSC=C4

Isomeric SMILES

CN1C(=NN=C1SC2=NC3=C(S2)C=C(C=C3)Cl)CC4=CSC=C4

InChI

InChI=1S/C15H11ClN4S3/c1-20-13(6-9-4-5-21-8-9)18-19-14(20)23-15-17-11-3-2-10(16)7-12(11)22-15/h2-5,7-8H,6H2,1H3