1-(4-butan-2-ylphenyl)-3-(4-chloranyl-1,3-benzothiazol-2-yl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(4-chloranyl-1,3-benzothiazol-2-yl)thiourea Openeye Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(4-chloro-1,3-benzothiazol-2-yl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(4-chloro-1,3-benzothiazol-2-yl)thiourea Traditional Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-(4-sec-butylphenyl)thiourea Formula: C18H18ClN3S2 MolecularWeight: 375.93862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)NC2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C18H18ClN3S2/c1-3-11(2)12-7-9-13(10-8-12)20-17(23)22-18-21-16-14(19)5-4-6-15(16)24-18/h4-11H,3H2,1-2H3,(H2,20,21,22,23)