N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-methyl-1,3-benzothiazol-2-imine

Systemtic Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-methyl-1,3-benzothiazol-2-imine Openeye Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-methyl-1,3-benzothiazol-2-imine CAS Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-methyl-1,3-benzothiazol-2-imine IUPAC Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-methyl-1,3-benzothiazol-2-imine Traditional Name: (E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]amine Formula: C21H19IN4S MolecularWeight: 486.37183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=NN=C3N(C4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)/C=N/N=C\3/N(C4=CC=CC=C4S3)C

InChI

InChI=1S/C21H19IN4S/c1-14-12-16(15(2)26(14)18-10-8-17(22)9-11-18)13-23-24-21-25(3)19-6-4-5-7-20(19)27-21/h4-13H,1-3H3/b23-13+,24-21-