1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloranyl-4,6-dimethyl-phenyl)thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloranyl-4,6-dimethyl-phenyl)thiourea Openeye Name: 1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloro-4,6-dimethyl-phenyl)thiourea CAS Name: 1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloro-4,6-dimethylphenyl)thiourea IUPAC Name: 1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloro-4,6-dimethylphenyl)thiourea Traditional Name: 1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-(2-chloro-4,6-dimethyl-phenyl)thiourea Formula: C18H18ClN3S2 MolecularWeight: 375.93862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NCCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NCCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H18ClN3S2/c1-11-9-12(2)17(13(19)10-11)22-18(23)20-8-7-16-21-14-5-3-4-6-15(14)24-16/h3-6,9-10H,7-8H2,1-2H3,(H2,20,22,23)