1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-(4-ethoxyphenyl)thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-(4-ethoxyphenyl)thiourea Openeye Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-(4-ethoxyphenyl)thiourea CAS Name: 1-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]amino]-3-(4-ethoxyphenyl)thiourea IUPAC Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-(4-ethoxyphenyl)thiourea Traditional Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-p-phenetyl-thiourea Formula: C18H19N5O2S2 MolecularWeight: 401.50576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)CNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NNC(=O)CNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N5O2S2/c1-2-25-13-9-7-12(8-10-13)20-17(26)23-22-16(24)11-19-18-21-14-5-3-4-6-15(14)27-18/h3-10H,2,11H2,1H3,(H,19,21)(H,22,24)(H2,20,23,26)