1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-[3-(methylthio)propyl]thiourea Formula: C19H21N3S3 MolecularWeight: 387.58514

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CSCCCNC(=S)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H21N3S3/c1-24-12-4-11-20-19(23)21-15-9-7-14(8-10-15)13-18-22-16-5-2-3-6-17(16)25-18/h2-3,5-10H,4,11-13H2,1H3,(H2,20,21,23)