1-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]-3-pentyl-thiourea

Systemtic Name: 1-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]-3-pentyl-thiourea Openeye Name: 1-[[(2S)-2-(6-methoxy-2-naphthyl)propanoyl]amino]-3-pentyl-thiourea CAS Name: 1-[[(2S)-2-(6-methoxy-2-naphthalenyl)-1-oxopropyl]amino]-3-pentylthiourea IUPAC Name: 1-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[(2S)-2-(6-methoxy-2-naphthyl)propanoyl]amino]thiourea Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C(C)C1=CC2=C(C=C1)C=C(C=C2)OC

Isomeric SMILES

CCCCCNC(=S)NNC(=O)[C@@H](C)C1=CC2=C(C=C1)C=C(C=C2)OC

InChI

InChI=1S/C20H27N3O2S/c1-4-5-6-11-21-20(26)23-22-19(24)14(2)15-7-8-17-13-18(25-3)10-9-16(17)12-15/h7-10,12-14H,4-6,11H2,1-3H3,(H,22,24)(H2,21,23,26)/t14-/m0/s1