1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-benzyl-thiourea CAS Name: 1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)-1-oxopropyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-benzylthiourea Traditional Name: 1-[[(2R)-2-(1,3-benzothiazol-2-ylamino)propanoyl]amino]-3-benzyl-thiourea Formula: C18H19N5OS2 MolecularWeight: 385.50636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NCC1=CC=CC=C1)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C(=O)NNC(=S)NCC1=CC=CC=C1)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N5OS2/c1-12(20-18-21-14-9-5-6-10-15(14)26-18)16(24)22-23-17(25)19-11-13-7-3-2-4-8-13/h2-10,12H,11H2,1H3,(H,20,21)(H,22,24)(H2,19,23,25)/t12-/m1/s1