1-[2-(2-azanylidene-1,3-benzothiazol-3-yl)ethanoylamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[2-(2-azanylidene-1,3-benzothiazol-3-yl)ethanoylamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[[2-(2-imino-1,3-benzothiazol-3-yl)acetyl]amino]thiourea CAS Name: 1-[[2-(2-imino-1,3-benzothiazol-3-yl)-1-oxoethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-[[2-(2-imino-1,3-benzothiazol-3-yl)acetyl]amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[[2-(2-imino-1,3-benzothiazol-3-yl)acetyl]amino]thiourea Formula: C13H15N5OS2 MolecularWeight: 321.4211

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=O)CN1C2=CC=CC=C2SC1=N

Isomeric SMILES

C=CCNC(=S)NNC(=O)CN1C2=CC=CC=C2SC1=N

InChI

InChI=1S/C13H15N5OS2/c1-2-7-15-13(20)17-16-11(19)8-18-9-5-3-4-6-10(9)21-12(18)14/h2-6,14H,1,7-8H2,(H,16,19)(H2,15,17,20)