(2S)-3-phenyl-N-(3-phenylpropyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanamide

Systemtic Name: (2S)-3-phenyl-N-(3-phenylpropyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanamide Openeye Name: (2S)-3-phenyl-N-(3-phenylpropyl)-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanamide CAS Name: (2S)-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]-3-phenyl-N-(3-phenylpropyl)propanamide IUPAC Name: (2S)-3-phenyl-N-(3-phenylpropyl)-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanamide Traditional Name: (2S)-3-phenyl-N-(3-phenylpropyl)-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propionamide Formula: C21H23N5O2S2 MolecularWeight: 441.56962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)C(CC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)NC3=NNC(=S)S3

InChI

InChI=1S/C21H23N5O2S2/c27-18(22-13-7-12-15-8-3-1-4-9-15)17(14-16-10-5-2-6-11-16)23-19(28)24-20-25-26-21(29)30-20/h1-6,8-11,17H,7,12-14H2,(H,22,27)(H,26,29)(H2,23,24,25,28)/t17-/m0/s1