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

Systemtic Name: 1-(4-chloranyl-1,3-benzothiazol-2-yl)-3-phenethyl-thiourea Openeye Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-phenethyl-thiourea CAS Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-phenethylthiourea IUPAC Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-phenethylthiourea Traditional Name: 1-(4-chloro-1,3-benzothiazol-2-yl)-3-phenethyl-thiourea Formula: C16H14ClN3S2 MolecularWeight: 347.88546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NC2=NC3=C(S2)C=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NC2=NC3=C(S2)C=CC=C3Cl

InChI

InChI=1S/C16H14ClN3S2/c17-12-7-4-8-13-14(12)19-16(22-13)20-15(21)18-10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H2,18,19,20,21)