N-[[4-chloranyl-2-(4-methoxyphenyl)imino-1,3-thiazol-5-ylidene]methyl]-4-methyl-piperazin-4-ium-1-amine

Systemtic Name: N-[[4-chloranyl-2-(4-methoxyphenyl)imino-1,3-thiazol-5-ylidene]methyl]-4-methyl-piperazin-4-ium-1-amine Openeye Name: N-[[4-chloro-2-(4-methoxyphenyl)imino-thiazol-5-ylidene]methyl]-4-methyl-piperazin-4-ium-1-amine CAS Name: N-[[4-chloro-2-(4-methoxyphenyl)imino-5-thiazolylidene]methyl]-4-methyl-1-piperazin-4-iumamine IUPAC Name: N-[[4-chloro-2-(4-methoxyphenyl)imino-1,3-thiazol-5-ylidene]methyl]-4-methylpiperazin-4-ium-1-amine Traditional Name: [4-chloro-2-(4-methoxyphenyl)imino-3-thiazolin-5-ylidene]methyl-(4-methylpiperazin-4-ium-1-yl)amine Formula: C16H21ClN5OS+ MolecularWeight: 366.88884

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC=C2C(=NC(=NC3=CC=C(C=C3)OC)S2)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC=C2C(=NC(=NC3=CC=C(C=C3)OC)S2)Cl

InChI

InChI=1S/C16H20ClN5OS/c1-21-7-9-22(10-8-21)18-11-14-15(17)20-16(24-14)19-12-3-5-13(23-2)6-4-12/h3-6,11,18H,7-10H2,1-2H3/p+1