1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-cyclopropyl-thiourea

Systemtic Name: 1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-cyclopropyl-thiourea Openeye Name: 1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-cyclopropyl-thiourea CAS Name: 1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)-1-oxopropyl]amino]-3-cyclopropylthiourea IUPAC Name: 1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-cyclopropylthiourea Traditional Name: 1-[[(2S)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-cyclopropyl-thiourea Formula: C14H17N5OS2 MolecularWeight: 335.44768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC1CC1)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@@H](C(=O)NNC(=S)NC1CC1)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H17N5OS2/c1-8(12(20)18-19-13(21)16-9-6-7-9)15-14-17-10-4-2-3-5-11(10)22-14/h2-5,8-9H,6-7H2,1H3,(H,15,17)(H,18,20)(H2,16,19,21)/t8-/m0/s1