N-(2-chloranyl-6-methyl-phenyl)-2-(2-dimethylaminoethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-(2-dimethylaminoethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-(2-dimethylaminoethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[(2-dimethylaminoethylamino)-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-(2-dimethylaminoethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-(2-dimethylaminoethylcarbamoylamino)-1,3-benzothiazole-6-carboxamide Formula: C20H22ClN5O2S MolecularWeight: 431.93898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCN(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCN(C)C

InChI

InChI=1S/C20H22ClN5O2S/c1-12-5-4-6-14(21)17(12)24-18(27)13-7-8-15-16(11-13)29-20(23-15)25-19(28)22-9-10-26(2)3/h4-8,11H,9-10H2,1-3H3,(H,24,27)(H2,22,23,25,28)