1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethyl-thiourea

Systemtic Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethyl-thiourea Openeye Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethyl-thiourea CAS Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethylthiourea IUPAC Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethylthiourea Traditional Name: 1-(2-methyl-1,3-benzothiazol-6-yl)-3-phenethyl-thiourea Formula: C17H17N3S2 MolecularWeight: 327.46698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3S2/c1-12-19-15-8-7-14(11-16(15)22-12)20-17(21)18-10-9-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H2,18,20,21)